| CAS Number | 352330-84-8 |
| Catalog Number | AG007F2T(AGN-PC-0WB3F1) |
| Chemical Name | 2-(2-Bromophenyl)-5-methyl-1,3,4-oxadiazole |
| IUPAC Name | 2-(2-bromophenyl)-5-methyl-1,3,4-oxadiazole |
| InChI | InChI=1S/C9H7BrN2O/c1-6-11-12-9(13-6)7-4-2-3-5-8(7)10/h2-5H,1H3 |
| InChI Key | QOMHHFGPICCGLG-UHFFFAOYSA-N |
| MDL Number | MFCD00842555 |
| Molecular Formula | C9H7BrN2O |
| Molecular Weight | 239.0687 |
| SMILES | C1(C2C=CC=CC=2Br)OC(=NN=1)C |
| Synonyms | 2-(2-BROMOPHENYL)-5-METHYL-1,3,4-OXADIAZOLE,
352330-84-8,
1,3,4-Oxadiazole, 2-(2-bromophenyl)-5-methyl-,
SCHEMBL4230324,
CTK4H3975,
DTXSID50589835,
ZINC5423638,
MFCD00842555,
AKOS004090655,
MCULE-5325216945,
AJ-54017,
FT-0759232,
EN300-79254,
W-7671,
CHEMBRDG-BB4010247,
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| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.072g/mol |
| Monoisotopic Mass | 237.974g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number